1-ethyl-3-[[(Z)-(5-nitro-2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]amino]thiourea

Systemtic Name: 1-ethyl-3-[[(Z)-(5-nitro-2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]amino]thiourea Openeye Name: 1-ethyl-3-[[(Z)-(2-hydroxy-5-nitro-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]amino]thiourea CAS Name: 1-ethyl-3-[[(Z)-(2-hydroxy-5-nitro-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]amino]thiourea IUPAC Name: 1-ethyl-3-[[(Z)-(2-hydroxy-5-nitro-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]amino]thiourea Traditional Name: 1-ethyl-3-[[(Z)-(2-hydroxy-4-keto-5-nitro-cyclohexa-2,5-dien-1-ylidene)methyl]amino]thiourea Formula: C10H12N4O4S MolecularWeight: 284.29168

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NNC=C1C=C(C(=O)C=C1O)[N+](=O)[O-]

Isomeric SMILES

CCNC(=S)NN/C=C\1/C=C(C(=O)C=C1O)[N+](=O)[O-]

InChI

InChI=1S/C10H12N4O4S/c1-2-11-10(19)13-12-5-6-3-7(14(17)18)9(16)4-8(6)15/h3-5,12,15H,2H2,1H3,(H2,11,13,19)/b6-5-